dimagnesium;hydride;hydrogen peroxide;hydroperoxyethane;zinc;hydrate

C2H13Mg2O5Zn- — CID 175177657

IUPACdimagnesium;hydride;hydrogen peroxide;hydroperoxyethane;zinc;hydrate
SMILESO.OO.[CH2-]COO.[H-].[H-].[H-].[H-].[Mg+2].[Mg+2].[Zn]
InChIInChI=1S/C2H5O2.2Mg.H2O2.H2O.Zn.4H/c1-2-4-3;;;1-2;;;;;;/h3H,1-2H2;;;1-2H;1H2;;;;;/q-1;2*+2;;;;4*-1
InChIKeyCRYNAEFQNPMEJU-UHFFFAOYSA-N
MW231.12 g/mol
LogP-0.81
Rot. Bonds1

About dimagnesium;hydride;hydrogen peroxide;hydroperoxyethane;zinc;hydrate

dimagnesium;hydride;hydrogen peroxide;hydroperoxyethane;zinc;hydrate (PubChem CID 175177657) has the molecular formula C2H13Mg2O5Zn- and a molecular weight of 231.12 g/mol. Its IUPAC name is dimagnesium;hydride;hydrogen peroxide;hydroperoxyethane;zinc;hydrate.

Molecular Properties

Compound Namedimagnesium;hydride;hydrogen peroxide;hydroperoxyethane;zinc;hydrate
PubChem CID175177657
Molecular FormulaC2H13Mg2O5Zn-
Molecular Weight231.12 g/mol
Exact Mass228.98
IUPAC Namedimagnesium;hydride;hydrogen peroxide;hydroperoxyethane;zinc;hydrate
SMILESO.OO.[CH2-]COO.[H-].[H-].[H-].[H-].[Mg+2].[Mg+2].[Zn]
InChIInChI=1S/C2H5O2.2Mg.H2O2.H2O.Zn.4H/c1-2-4-3;;;1-2;;;;;;/h3H,1-2H2;;;1-2H;1H2;;;;;/q-1;2*+2;;;;4*-1
InChIKeyCRYNAEFQNPMEJU-UHFFFAOYSA-N
XLogP-0.81
TPSA101.42 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.12
LogP ≤ 5-0.81
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'peroxide', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of dimagnesium;hydride;hydrogen peroxide;hydroperoxyethane;zinc;hydrate?
The IUPAC name of dimagnesium;hydride;hydrogen peroxide;hydroperoxyethane;zinc;hydrate (CID 175177657) is dimagnesium;hydride;hydrogen peroxide;hydroperoxyethane;zinc;hydrate.
What is the SMILES notation for dimagnesium;hydride;hydrogen peroxide;hydroperoxyethane;zinc;hydrate?
The canonical SMILES for dimagnesium;hydride;hydrogen peroxide;hydroperoxyethane;zinc;hydrate is O.OO.[CH2-]COO.[H-].[H-].[H-].[H-].[Mg+2].[Mg+2].[Zn].
What is the InChIKey of dimagnesium;hydride;hydrogen peroxide;hydroperoxyethane;zinc;hydrate?
The InChIKey is CRYNAEFQNPMEJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H5O2.2Mg.H2O2.H2O.Zn.4H/c1-2-4-3;;;1-2;;;;;;/h3H,1-2H2;;;1-2H;1H2;;;;;/q-1;2*+2;;;;4*-1.
What are the key properties of dimagnesium;hydride;hydrogen peroxide;hydroperoxyethane;zinc;hydrate?
dimagnesium;hydride;hydrogen peroxide;hydroperoxyethane;zinc;hydrate has a molecular weight of 231.12 g/mol, XLogP of -0.81, 1 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for dimagnesium;hydride;hydrogen peroxide;hydroperoxyethane;zinc;hydrate is sourced from PubChem (CID 175177657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).